3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(3-methylsulfonylphenyl)propanamide

Systemtic Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(3-methylsulfonylphenyl)propanamide Openeye Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(3-methylsulfonylphenyl)propanamide CAS Name: 3-(2,4-dimethyl-3-pyrimido[1,2-b]indazolyl)-N-(3-methylsulfonylphenyl)propanamide IUPAC Name: 3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)-N-(3-methylsulfonylphenyl)propanamide Traditional Name: 3-(2,4-dimethylpyrimid[1,2-b]indazol-3-yl)-N-(3-mesylphenyl)propionamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=C3C=CC=CC3=NN12)C)CCC(=O)NC4=CC(=CC=C4)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=NC2=C3C=CC=CC3=NN12)C)CCC(=O)NC4=CC(=CC=C4)S(=O)(=O)C

InChI

InChI=1S/C22H22N4O3S/c1-14-18(15(2)26-22(23-14)19-9-4-5-10-20(19)25-26)11-12-21(27)24-16-7-6-8-17(13-16)30(3,28)29/h4-10,13H,11-12H2,1-3H3,(H,24,27)